3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium

Systemtic Name: 3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium Openeye Name: 3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium CAS Name: 3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium IUPAC Name: 3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium Traditional Name: 3-(2,6-dimethylphenyl)-1-methyl-1,6,8-triphenyl-2H-quinazoline-1,3-diium Formula: C35H32N2+2 MolecularWeight: 480.64198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)[N+]2=CC3=CC(=CC(=C3[N+](C2)(C)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=C(C(=CC=C1)C)[N+]2=CC3=CC(=CC(=C3[N+](C2)(C)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H32N2/c1-26-14-13-15-27(2)34(26)36-24-31-22-30(28-16-7-4-8-17-28)23-33(29-18-9-5-10-19-29)35(31)37(3,25-36)32-20-11-6-12-21-32/h4-24H,25H2,1-3H3/q+2